(2S)-2-[[(2S)-2-[(5-methoxy-1-methyl-indol-2-yl)carbonylamino]-3-methyl-butanoyl]amino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[[(2S)-2-[(5-methoxy-1-methyl-indol-2-yl)carbonylamino]-3-methyl-butanoyl]amino]-3-methyl-butanoate Openeye Name: (2S)-2-[[(2S)-2-[(5-methoxy-1-methyl-indole-2-carbonyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2S)-2-[[(5-methoxy-1-methyl-2-indolyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[[(2S)-2-[(5-methoxy-1-methylindole-2-carbonyl)amino]-3-methylbutanoyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[(2S)-2-[(5-methoxy-1-methyl-indole-2-carbonyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butyrate Formula: C21H28N3O5- MolecularWeight: 402.46412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C(C)C)C(=O)[O-])NC(=O)C1=CC2=C(N1C)C=CC(=C2)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)[O-])NC(=O)C1=CC2=C(N1C)C=CC(=C2)OC

InChI

InChI=1S/C21H29N3O5/c1-11(2)17(20(26)23-18(12(3)4)21(27)28)22-19(25)16-10-13-9-14(29-6)7-8-15(13)24(16)5/h7-12,17-18H,1-6H3,(H,22,25)(H,23,26)(H,27,28)/p-1/t17-,18-/m0/s1